(Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-dodec-2-enoic acid

Systemtic Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-dodec-2-enoic acid Openeye Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-dodec-2-enoic acid CAS Name: (Z)-2-(5-hexyl-2-pyrimidinyl)-4-phenyl-2-dodecenoic acid IUPAC Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyldodec-2-enoic acid Traditional Name: (Z)-2-(5-hexylpyrimidin-2-yl)-4-phenyl-dodec-2-enoic acid Formula: C28H40N2O2 MolecularWeight: 436.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C=C(C1=NC=C(C=N1)CCCCCC)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC(/C=C(/C1=NC=C(C=N1)CCCCCC)\C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C28H40N2O2/c1-3-5-7-9-10-13-19-25(24-17-14-11-15-18-24)20-26(28(31)32)27-29-21-23(22-30-27)16-12-8-6-4-2/h11,14-15,17-18,20-22,25H,3-10,12-13,16,19H2,1-2H3,(H,31,32)/b26-20-